3QE5
Complete structure of Streptococcus mutans Antigen I/II carboxy-terminus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 93 |
Detector technology | CCD |
Collection date | 2007-12-07 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 108.495, 156.360, 213.648 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.000 - 2.500 |
R-factor | 0.208 |
Rwork | 0.208 |
R-free | 0.24400 |
Structure solution method | MIR |
RMSD bond length | 0.008 |
RMSD bond angle | 1.411 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHARP |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Number of reflections | 60205 | |
<I/σ(I)> | 24.5 | 3.59 |
Completeness [%] | 97.0 | 81.2 |
Redundancy | 6.9 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 298 | 11% PEG6000, 2 M NaCl, 55 mM sodium succinate, pH 4.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |